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2-Chloroacetyl-1-phenyl-1,2,3,4-tetrahydro-.beta.-carboline
SpectraBase Compound ID APQau4tB0Pk
InChI InChI=1S/C19H17ClN2O/c20-12-17(23)22-11-10-15-14-8-4-5-9-16(14)21-18(15)19(22)13-6-2-1-3-7-13/h1-9,19,21H,10-12H2
InChIKey HVAJSMUIHBSTQN-UHFFFAOYSA-N
Mol Weight 324.81 g/mol
Molecular Formula C19H17ClN2O
Exact Mass 324.102941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CrZhB3hkFc
Name 2-Chloroacetyl-1-phenyl-1,2,3,4-tetrahydro-.beta.-carboline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.102940874 u
Formula C19H17ClN2O
InChI InChI=1S/C19H17ClN2O/c20-12-17(23)22-11-10-15-14-8-4-5-9-16(14)21-18(15)19(22)13-6-2-1-3-7-13/h1-9,19,21H,10-12H2
InChIKey HVAJSMUIHBSTQN-UHFFFAOYSA-N
Molecular Weight 324.811 g/mol
SMILES C12=C(NC3=C2CCN(C3C2=CC=CC=C2)C(CCl)=O)C=CC=C1